2-phenyl-6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one

Systemtic Name: 2-phenyl-6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-phenyl-6-[4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one CAS Name: 6-[oxo-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methyl]-2-phenyl-4,5-dihydropyridazin-3-one IUPAC Name: 2-phenyl-6-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-phenyl-6-[4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Formula: C21H20F3N5O2 MolecularWeight: 431.41101

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(N=C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(N=C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C21H20F3N5O2/c22-21(23,24)15-6-8-18(25-14-15)27-10-12-28(13-11-27)20(31)17-7-9-19(30)29(26-17)16-4-2-1-3-5-16/h1-6,8,14H,7,9-13H2